N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-1-cycloheptyl-methanamine

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-1-cycloheptyl-methanamine Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-imidazol-4-yl)methyl]-1-cycloheptyl-methanamine CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenyl-4-imidazolyl)methyl]-1-cycloheptylmethanamine IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-N-[(3-butyl-2-phenylimidazol-4-yl)methyl]-1-cycloheptylmethanamine Traditional Name: (3-butyl-2-phenyl-imidazol-4-yl)methyl-(cycloheptylmethyl)-piperonyl-amine Formula: C30H39N3O2 MolecularWeight: 473.64956

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1C2=CC=CC=C2)CN(CC3CCCCCC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CCCCN1C(=CN=C1C2=CC=CC=C2)CN(CC3CCCCCC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C30H39N3O2/c1-2-3-17-33-27(19-31-30(33)26-13-9-6-10-14-26)22-32(20-24-11-7-4-5-8-12-24)21-25-15-16-28-29(18-25)35-23-34-28/h6,9-10,13-16,18-19,24H,2-5,7-8,11-12,17,20-23H2,1H3